UCSF

ZINC70101584

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 4th, 2011 18 Yes

Popular Name: 5-[(1R)-1-[[(1R)-2-cyclopropyl-1-methyl-ethyl]amino]ethyl]-2,4-dimethyl-1H-pyrimidin-6-one 5-[(1R)-1-[[(1R)-2-cyclopropyl-1…

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Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.50 6.02 -31.62 3 4 1 62 250.366 5 ↓
Hi High (pH 8-9.5) 1.50 5.02 -8.41 2 4 0 58 249.358 5 ↓

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Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.